[4-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-[(3-fluorophenyl)methyl]-methyl-azanium

Systemtic Name: [4-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-[(3-fluorophenyl)methyl]-methyl-azanium Openeye Name: [4-(azaniumylmethyl)-2-fluoro-phenyl]methyl-[(3-fluorophenyl)methyl]-methyl-ammonium CAS Name: [4-(ammoniomethyl)-2-fluorophenyl]methyl-[(3-fluorophenyl)methyl]-methylammonium IUPAC Name: [4-(azaniumylmethyl)-2-fluorophenyl]methyl-[(3-fluorophenyl)methyl]-methylazanium Traditional Name: [4-(ammoniomethyl)-2-fluoro-benzyl]-(3-fluorobenzyl)-methyl-ammonium Formula: C16H20F2N2+2 MolecularWeight: 278.340206

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)F)CC2=C(C=C(C=C2)C[NH3+])F

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)F)CC2=C(C=C(C=C2)C[NH3+])F

InChI

InChI=1S/C16H18F2N2/c1-20(10-13-3-2-4-15(17)7-13)11-14-6-5-12(9-19)8-16(14)18/h2-8H,9-11,19H2,1H3/p+2